Lehrstuhl für Theoretische Chemie

Facile Access to Challenging ortho-Terphenyls via Merging Two Multi-Step Domino Reactions in One-Pot: A Joint Experimental/Theoretical Study (2019) Grau B, Bönisch S, Neuhauser A, Hampel F, Görling A, Tsogoeva S Journal article Hierarchies of methods towards the exact Kohn-Sham correlation energy based on the adiabatic-connection fluctuation-dissipation theorem (2019) Görling A Journal article Solar energy storage at an atomically defined organic-oxide hybrid interface (2019) Schuschke C, Hohner C, Jevric M, Petersen AU, Wang Z, Schwarz M, Kettner M, et al. Journal article The Feynman dispersion correction for MNDO extended to F, Cl, Br and I (2019) Kriebel M, Heßelmann A, Hennemann M, Clark T Journal article Surface chemistry of 2,3-dibromosubstituted norbornadiene/quadricyclane as molecular solar thermal energy storage system on Ni(111) (2019) Bauer U, Fromm L, Weiß C, Späth F, Bachmann P, Düll F, Steinhauer J, et al. Journal article Identification of novel MRGX2-agonists triggering mast cell degranulation and potentially mediating drug-induced pruritus (2019) Kühn H, Wolf K, Boehm F, Glaudo M, Gebhardt L, Ectors P, Agelopoulos K, et al. Conference contribution Comment on "physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods" (2019) Jordan KD, Heßelmann A Journal article Operando DRIFTS and DFT Study of Propane Dehydrogenation over Solid- and Liquid-Supported GaxPty Catalysts (2019) Bauer T, Maisel S, Blaumeiser D, Vecchietti J, Taccardi N, Wasserscheid P, Bonivardi A, et al. Journal article Benchmarking and optimization of molecular simulation models of zinc dialkyldithiophosphate and calcium sulfonate oil additives (2019) Ectors P, Zahn D Journal article Use of oleophilic magnetite nanoparticles as efficient sorbent for water contaminants (2019) Sarcletti M, Vivod D, Luchs T, Rejek T, Portilla L, Hirsch A, Zahn D, Halik M Conference contribution, Conference Contribution